4-(4-chlorophenyl)piperidine-2,6-dione

C11H10ClNO2 — CID 2727728

IUPAC4-(4-chlorophenyl)piperidine-2,6-dione
SMILESO=C1CC(c2ccc(Cl)cc2)CC(=O)N1
InChIInChI=1S/C11H10ClNO2/c12-9-3-1-7(2-4-9)8-5-10(14)13-11(15)6-8/h1-4,8H,5-6H2,(H,13,14,15)
InChIKeyKOZWYRYCGOBBKD-UHFFFAOYSA-N
MW223.66 g/mol
LogP1.86
Rot. Bonds1

About 4-(4-chlorophenyl)piperidine-2,6-dione

4-(4-chlorophenyl)piperidine-2,6-dione (PubChem CID 2727728) has the molecular formula C11H10ClNO2 and a molecular weight of 223.66 g/mol. Its IUPAC name is 4-(4-chlorophenyl)piperidine-2,6-dione.

Molecular Properties

Compound Name4-(4-chlorophenyl)piperidine-2,6-dione
PubChem CID2727728
Molecular FormulaC11H10ClNO2
Molecular Weight223.66 g/mol
Exact Mass223.04
IUPAC Name4-(4-chlorophenyl)piperidine-2,6-dione
SMILESO=C1CC(c2ccc(Cl)cc2)CC(=O)N1
InChIInChI=1S/C11H10ClNO2/c12-9-3-1-7(2-4-9)8-5-10(14)13-11(15)6-8/h1-4,8H,5-6H2,(H,13,14,15)
InChIKeyKOZWYRYCGOBBKD-UHFFFAOYSA-N
XLogP1.86
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.66
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)piperidine-2,6-dione?
The IUPAC name of 4-(4-chlorophenyl)piperidine-2,6-dione (CID 2727728) is 4-(4-chlorophenyl)piperidine-2,6-dione.
What is the SMILES notation for 4-(4-chlorophenyl)piperidine-2,6-dione?
The canonical SMILES for 4-(4-chlorophenyl)piperidine-2,6-dione is O=C1CC(c2ccc(Cl)cc2)CC(=O)N1.
What is the InChIKey of 4-(4-chlorophenyl)piperidine-2,6-dione?
The InChIKey is KOZWYRYCGOBBKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClNO2/c12-9-3-1-7(2-4-9)8-5-10(14)13-11(15)6-8/h1-4,8H,5-6H2,(H,13,14,15).
What are the key properties of 4-(4-chlorophenyl)piperidine-2,6-dione?
4-(4-chlorophenyl)piperidine-2,6-dione has a molecular weight of 223.66 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)piperidine-2,6-dione is sourced from PubChem (CID 2727728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).